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Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with Target = 'Hypoxia-inducible factor 1-alpha' and Ligand = 'BDBM50393281'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Hypoxia-inducible factor 1-alpha


(Homo sapiens (Human))
BDBM50393281
PNG
(CHEMBL2139973)
Show SMILES Cc1cccc(CNc2nc(nnc2-c2ccccc2)-c2ccccn2)c1
Show InChI InChI=1S/C22H19N5/c1-16-8-7-9-17(14-16)15-24-22-20(18-10-3-2-4-11-18)26-27-21(25-22)19-12-5-6-13-23-19/h2-14H,15H2,1H3,(H,24,25,27)
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Article
PubMed
n/an/an/an/a 5.41E+3n/an/an/an/a



The Broad Institute Probe Development Center

Curated by ChEMBL


Assay Description
Activation of human HIF1alpha expressed in DFX-induced human U2OS cells incubated for 30 mins prior to DFX-induction measured after overnight incubat...


Bioorg Med Chem Lett 22: 76-81 (2011)


Article DOI: 10.1016/j.bmcl.2011.11.077
BindingDB Entry DOI: 10.7270/Q2XD12SN
More data for this
Ligand-Target Pair
Hypoxia-inducible factor 1-alpha


(Homo sapiens (Human))
BDBM50393281
PNG
(CHEMBL2139973)
Show SMILES Cc1cccc(CNc2nc(nnc2-c2ccccc2)-c2ccccn2)c1
Show InChI InChI=1S/C22H19N5/c1-16-8-7-9-17(14-16)15-24-22-20(18-10-3-2-4-11-18)26-27-21(25-22)19-12-5-6-13-23-19/h2-14H,15H2,1H3,(H,24,25,27)
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Article
PubMed
n/an/an/an/a 2.91E+3n/an/an/an/a



The Broad Institute Probe Development Center

Curated by ChEMBL


Assay Description
Activation of human HIF1alpha expressed in human U2OS cells assessed as increase in VEGF expression by RT-PCR analysis


Bioorg Med Chem Lett 22: 76-81 (2011)


Article DOI: 10.1016/j.bmcl.2011.11.077
BindingDB Entry DOI: 10.7270/Q2XD12SN
More data for this
Ligand-Target Pair
Hypoxia-inducible factor 1-alpha


(Homo sapiens (Human))
BDBM50393281
PNG
(CHEMBL2139973)
Show SMILES Cc1cccc(CNc2nc(nnc2-c2ccccc2)-c2ccccn2)c1
Show InChI InChI=1S/C22H19N5/c1-16-8-7-9-17(14-16)15-24-22-20(18-10-3-2-4-11-18)26-27-21(25-22)19-12-5-6-13-23-19/h2-14H,15H2,1H3,(H,24,25,27)
PDB

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KEGG

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PC sid
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Article
PubMed
n/an/an/an/a 2.39E+3n/an/an/an/a



The Broad Institute Probe Development Center

Curated by ChEMBL


Assay Description
Activation of GFP-tagged HIF1alpha expressed in human U2OS cells assessed as HIF1alpha nuclear translocation by high content imaging assay


Bioorg Med Chem Lett 22: 76-81 (2011)


Article DOI: 10.1016/j.bmcl.2011.11.077
BindingDB Entry DOI: 10.7270/Q2XD12SN
More data for this
Ligand-Target Pair